ethyl 3-[(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[(2-acetamido-4,5-dimethyl-3-thiophenyl)-oxomethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-acetamido-4,5-dimethylthiophene-3-carbonyl)oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)oxymethyl]coumarilic acid ethyl ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=C(SC(=C3C)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=C(SC(=C3C)C)NC(=O)C

InChI

InChI=1S/C21H21NO6S/c1-5-26-21(25)18-15(14-8-6-7-9-16(14)28-18)10-27-20(24)17-11(2)12(3)29-19(17)22-13(4)23/h6-9H,5,10H2,1-4H3,(H,22,23)